Ran, Y.; He, Y.; Yang, G.; Johnson, J. L. H.; Yalkowsky, S. H. Estimation of aqueous solubility of organic compounds by using the general solubility equation. Chemosphere 2002, 48, 487–509.

Compound

	ID:	395
	Name:	Warfarin
	Description:
	Labels:
	CAS:	81-81-2
	InChi Code:	InChI=1S/C19H16O4/c1-12(20)11-15(13-7-3-2-4-8-13)17-18(21)14-9-5-6-10-16(14)23-19(17)22/h2-10,15,21H,11H2,1H3

Properties

MlogP: Measured octanol/water partition coefficient as logP

Value	Source or prediction
2.7	experimental value

logSobs: Aqueous solubility as logS [mol/L]

Value	Source or prediction
-3.89	experimental value
-3.75	Eq.1: General solubility equation (Test set to verify GSE)

Links to External Resources

Link	Resource description
DTXSID5023742	US EPA CompTox Dashboard